{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.506011 -0.442354 0.5122689 ] [ -1.2128593 2.0185263 0.8468924 ] [ 0.2834226 -2.4002813 -0.531281 ] [ 0.2820603 1.1820418 2.3132656 ] [ 0.3007165 0.6180977 0.6602567 ] [ 2.0597018 0.482366 -4.1949971 ] [ -0.2070309 -1.4583964 0.3935945 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.412895634746974e-09 -7.08729242756436e-10 8.207452619048826e-10 ] [ -1.943214830789596e-09 3.234035672974474e-09 1.356871214792181e-09 ] [ 4.540930672675284e-10 -3.845674613887144e-09 -8.51206004288154e-10 ] [ 4.519104220390301e-10 1.893839752371301e-09 3.70626009255599e-09 ] [ 4.818009497582609e-10 9.903016924691416e-10 1.057847857181948e-09 ] [ 3.300006096967741e-09 7.72835534236044e-10 -6.721126333317761e-09 ] [ -3.317000704959906e-10 -2.336608635189718e-09 6.30607911170913e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.41707706491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.630305727198634e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9152013 2.4891481 1.0487951 ] [ 2.4294315 2.9232541 3.5087137 ] [ 3.4679163 0.9746157 2.3172357 ] [ 5.0268959 3.0337978 3.6377465 ] [ 3.0542387 4.9151294 1.3116969 ] [ 4.5203109 3.0172355 1.1697856 ] [ 3.7537725 5.0654004 3.5516854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9152013e-10 2.4891481e-10 1.0487951e-10 ] [ 2.4294315e-10 2.9232541e-10 3.5087137e-10 ] [ 3.4679163e-10 9.746157000000001e-11 2.3172357e-10 ] [ 5.026895900000001e-10 3.0337978e-10 3.6377465e-10 ] [ 3.0542387e-10 4.9151294e-10 1.3116969e-10 ] [ 4.5203109e-10 3.0172355e-10 1.1697856e-10 ] [ 3.753772500000001e-10 5.0654004e-10 3.5516854e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 7.7e-06 2.07e-05 ] [ -3.13e-05 -3.09e-05 -1.09e-05 ] [ 6.1e-06 -2.21e-05 -2.6e-06 ] [ 2.54e-05 -1.33e-05 1.13e-05 ] [ 8.7e-06 2.73e-05 1.34e-05 ] [ -4.2e-06 4e-06 8.9e-06 ] [ -3.7e-06 2.72e-05 -4.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-15 1.23367600818e-14 3.316505632379999e-14 ] [ -5.014812864419999e-14 -4.950725799059999e-14 -1.74637253106e-14 ] [ 9.773277467399999e-15 -3.54081036114e-14 -4.165659248399999e-15 ] [ 4.06952865036e-14 -2.13089492322e-14 1.81045959642e-14 ] [ 1.39389367158e-14 4.37394221082e-14 2.14691668956e-14 ] [ -6.729141862799999e-15 6.408706535999999e-15 1.42593720426e-14 ] [ -5.9280535458e-15 4.35792044448e-14 -6.53688066672e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.047526064916394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.891532456271501e-18 } }